Vitas-M small molecule compound

methyl 5-(morpholin-4-ylsulfonyl)-2,4-bis(pyridin-2-ylsulfanyl)benzoate

Catalog ID
STL300913
SMILES COC(=O)c1cc(c(cc1Sc1ccccn1)Sc1ccccn1)S(=O)(=O)N1CCOCC1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H21N3O5S3 MW 503.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5S3/c1-29-22(26)16-14-19(33(27,28)25-10-12-30-13-11-25)18(32-21-7-3-5-9-24-21)15-17(16)31-20-6-2-4-8-23-20/h2-9,14-15H,10-13H2,1H3
InChIKey
CSNPXCMLZLLLMN-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC(=C(C=C1SC2=CC=CC=N2)SC3=CC=CC=N3)S(=O)(=O)N4CCOCC4
InChI=1SC22H21N3O5S3c12922(26)161419(33(2728)25101230131125)18(322173592421)1517(16)312062482320h291415H1013H21H3
methyl5(morpholin4ylsulfonyl)24bis(pyridin2ylsulfanyl)benzoate
methyl5(morpholinosulfonyl)24bis(pyridin2ylthio)benzoate
METHYL5MORPHOLIN4YLSULFONYL24BIS(PYRIDIN2YLSULFANYL)BENZOATE
MFCD02127669
ZINC000006489593
ZINC06489593
ZINC6489593

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.